3-(4-chlorophenyl)-1-(1H-indol-3-yl)-2-oxidanyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(4-chlorophenyl)-1-(1H-indol-3-yl)-2-oxidanyl-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(4-chlorophenyl)-2-hydroxy-1-(1H-indol-3-yl)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one CAS Name: 3-(4-chlorophenyl)-2-hydroxy-1-(1H-indol-3-yl)-3-[4-(2-pyrimidinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4-chlorophenyl)-2-hydroxy-1-(1H-indol-3-yl)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-(4-chlorophenyl)-2-hydroxy-1-(1H-indol-3-yl)-3-[4-(2-pyrimidyl)piperazino]propan-1-one Formula: C25H24ClN5O2 MolecularWeight: 461.94336

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(C3=CC=C(C=C3)Cl)C(C(=O)C4=CNC5=CC=CC=C54)O

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(C3=CC=C(C=C3)Cl)C(C(=O)C4=CNC5=CC=CC=C54)O

InChI

InChI=1S/C25H24ClN5O2/c26-18-8-6-17(7-9-18)22(30-12-14-31(15-13-30)25-27-10-3-11-28-25)24(33)23(32)20-16-29-21-5-2-1-4-19(20)21/h1-11,16,22,24,29,33H,12-15H2